data_image0
_chemical_formula_structural       I2Pt2
_chemical_formula_sum              "I2 Pt2"
_cell_length_a       3.897932832346589
_cell_length_b       3.897932832346589
_cell_length_c       18.889087296526014
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  'x, y, z'

loop_
  _atom_site_type_symbol
  _atom_site_label
  _atom_site_symmetry_multiplicity
  _atom_site_fract_x
  _atom_site_fract_y
  _atom_site_fract_z
  _atom_site_occupancy
  I   I1        1.0  1.7931727391750024e-16  2.0208503424890724e-16  0.6115727473165427  1.0000
  I   I2        1.0  0.5000000000000001  0.5000000000000001  0.3884271916547913  1.0000
  Pt  Pt1       1.0  0.5000000000000001  1.4786144757019803e-16  0.49999988078198704  1.0000
  Pt  Pt2       1.0  1.482757446390916e-16  0.5000000000000001  0.49999988078198704  1.0000